HRID1135306

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID75927

Phenol, 3,4-difluoro-

C6H4F2O

HCID84223

4-Chloro-3-ethylphenol

C8H9ClO

HCID2783381

3-Bromo-4-Fluorophenol

C6H4BrFO

HCID13850044

未命名化合物

PRODUCTS

生成物

HCID2737390

6-Fluoro-2-methyl-4-chromanone

C10H9FO2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dd91c37380fc451f9d01d71f27517496
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[Br:24][c:25]1[cH:26][c:27]([OH:28])[cH:29][cH:30][c:31]1[F:32].[Br:33][c:34]1[c:35]([F:36])[cH:37][cH:38][c:39]2[c:40]1[C:41](=[O:42])[CH2:43][CH:44]([CH3:45])[O:46]2.[Br:47][c:48]1[cH:49][c:50]2[c:51]([cH:58][c:59]1[F:60])[C:52](=[O:53])[CH2:54][CH:55]([CH3:56])[O:57]2.[Cl:61][c:62]1[cH:63][cH:64][c:65]([OH:66])[cH:67][c:68]1[CH2:69][CH3:70].[Cl:71][c:72]1[cH:73][c:74]2[c:75]([cH:76][c:77]1[CH2:78][CH3:79])[O:80][CH:81]([CH3:82])[CH2:83][C:84]2=[O:85].[F:10][c:11]1[cH:12][c:13]2[c:18]([cH:19][c:20]1[F:21])[O:17][CH:16]([CH3:22])[CH2:15][C:14]2=[O:23].[F:1][c:2]1[cH:3][c:4]([OH:5])[cH:6][cH:7][c:8]1[F:9]>>[F:10][c:11]1[cH:12][c:13]2[c:18]([cH:19][cH:20]1)[O:17][CH:16]([CH3:22])[CH2:15][C:14]2=[O:23]